ethyl 5-(3-methylbutanamido)-1-{2-[(3-methylbutanoyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-methylbutanamido)-1-{2-[(3-methylbutanoyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
ethyl 5-(3-methylbutanamido)-1-{2-[(3-methylbutanoyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | C691-0038 |
| Compound Name: | ethyl 5-(3-methylbutanamido)-1-{2-[(3-methylbutanoyl)oxy]ethyl}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 367.44 |
| Molecular Formula: | C18 H29 N3 O5 |
| Smiles: | CCOC(c1cnn(CCOC(CC(C)C)=O)c1NC(CC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0873 |
| logD: | 2.9373 |
| logSw: | -3.212 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.445 |
| InChI Key: | HZDZEAXVCQVBOJ-UHFFFAOYSA-N |